CID 61252399

4-hydroxy-1-(pyrimidin-4-yl)pyrrolidine-2-carboxylic acid hydrochloride

Structural Information

Molecular Formula
C9H11N3O3
SMILES
C1C(CN(C1C(=O)O)C2=NC=NC=C2)O
InChI
InChI=1S/C9H11N3O3/c13-6-3-7(9(14)15)12(4-6)8-1-2-10-5-11-8/h1-2,5-7,13H,3-4H2,(H,14,15)
InChIKey
WSMJKBXOBIAVKU-UHFFFAOYSA-N
Compound name
4-hydroxy-1-pyrimidin-4-ylpyrrolidine-2-carboxylic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

209.08005 Da
Monoisotopic Mass

-0.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 210.08733 145.3
[M+Na]+ 232.06927 155.5
[M+NH4]+ 227.11387 150.9
[M+K]+ 248.04321 153.9
[M-H]- 208.07277 144.7
[M+Na-2H]- 230.05472 149.6
[M]+ 209.07950 146.1
[M]- 209.08060 146.1
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

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No literature data available for this compound.

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No patent data available for this compound.